SCHEMBL5990273

SCHEMBL5990273

CCCOc1ccc(C(=O)CN2CCOCC2)cc1Cc1nc2c(CCC)n[nH]c2c(=O)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 10/20 0.50
▸ PDE6C P51160 2/20 0.50
▸ PDE1A P54750 3/20 0.44
▸ PDE1B Q01064 3/20 0.44
▸ PDE1C Q14123 3/20 0.44
▸ PDE9A O76083 2/20 0.44
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ USP2 O75604 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ TLR7 Q9NYK1 1/20 0.35
▸ PDE11A Q9HCR9 1/20 0.35
▸ TNKS O95271 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5085823 0.95 PDE5A (0.56) PDE5APDE6CPDE1APDE1BPDE1C
SCHEMBL17333641 0.88 PDE5A (0.47) PDE5APDE6CPDE1APDE1BPDE1C
SCHEMBL6058528 0.86 PDE5A (0.67) PDE5APDE6CPDE1APDE1BPDE1C
SCHEMBL1872915 0.80 PDE5A (0.58) PDE5APDE6CPDE1APDE1BPDE1C
SCHEMBL7019558 0.77 PARP1 (0.41) PDE5APDE6CPDE1APDE1BPDE1C
SCHEMBL5085819 0.74 PDE5A (0.65) PDE5APDE6CALDH1A1MAPTHTT
SCHEMBL7167750 0.72 PDE5A (0.54) PDE5APDE6CALDH1A1MAPTHTT
SCHEMBL29611957 0.72 PDE5A (0.90) PDE5APDE6C
SCHEMBL146830 0.72 PDE5A (0.90) PDE5APDE6C
SCHEMBL6058531 0.71 PDE5A (0.55) PDE5APDE6CALDH1A1MAPTHTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1418896-A2 ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF PREMATURE EJACULATION Vivus, Inc. (US) 2004-05-19 — — EP claimed
WO-2003000343-A2 ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF PREMATURE EJACULATION VIVUS, INC. (US) 2003-01-03 — — WO claimed
US-20060040935-A1 Method of treating impotence due to spinal cord injury PFIZER INC 2006-02-23 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060040935-A1 Method of treating impotence due to spinal cord injury PDE3A, PDE3B, PDE5A PDE5A 3/4885PDE6C 16/4885PDE1A 33/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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